3-[[2,4-bis(fluoranyl)phenyl]methyl]-3-methanoyl-piperazine-1-carboxylic acid

Systemtic Name: 3-[[2,4-bis(fluoranyl)phenyl]methyl]-3-methanoyl-piperazine-1-carboxylic acid Openeye Name: 3-[(2,4-difluorophenyl)methyl]-3-formyl-piperazine-1-carboxylic acid CAS Name: 3-[(2,4-difluorophenyl)methyl]-3-formyl-1-piperazinecarboxylic acid IUPAC Name: 3-[(2,4-difluorophenyl)methyl]-3-formylpiperazine-1-carboxylic acid Traditional Name: 3-(2,4-difluorobenzyl)-3-formyl-piperazine-1-carboxylic acid Formula: C13H14F2N2O3 MolecularWeight: 284.258666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)(CC2=C(C=C(C=C2)F)F)C=O)C(=O)O

Isomeric SMILES

C1CN(CC(N1)(CC2=C(C=C(C=C2)F)F)C=O)C(=O)O

InChI

InChI=1S/C13H14F2N2O3/c14-10-2-1-9(11(15)5-10)6-13(8-18)7-17(12(19)20)4-3-16-13/h1-2,5,8,16H,3-4,6-7H2,(H,19,20)